SCHEMBL412302

SCHEMBL412302

O=S(=O)(NCCc1ccccc1)c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.79
PRMT1 Q99873 3/20 0.77
TAAR1 Q96RJ0 1/20 0.77
TDP1 Q9NUW8 1/20 0.77
HSD17B10 Q99714 1/20 0.77
CA1 P00915 1/20 0.75
CA2 P00918 1/20 0.75
MAPT P10636 1/20 0.71
POLB P06746 1/20 0.71
AKR1C3 P42330 1/20 0.67
KEAP1 Q14145 1/20 0.66
KDM4E B2RXH2 1/20 0.66
LMNA P02545 1/20 0.66
PKM P14618 1/20 0.66
SMN1; SMN2 Q16637 1/20 0.66
MEN1 O00255 1/20 0.65
KMT2A Q03164 1/20 0.65
NPSR1 Q6W5P4 1/20 0.65
GAA P10253 1/20 0.64
TBXA2R P21731 1/20 0.63

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Hydrochloric Acid SCHEMBL3517769 0.98 ALDH1A1 (0.77) ALDH1A1PRMT1TAAR1TDP1HSD17B10
SCHEMBL407477 0.89 ALDH1A1 (1.00) ALDH1A1PRMT1TAAR1TDP1HSD17B10
SCHEMBL11177620 0.88 TDP1 (1.00) ALDH1A1PRMT1TAAR1TDP1HSD17B10
SCHEMBL5187812 0.88 TDP1 (0.67) ALDH1A1PRMT1TAAR1TDP1HSD17B10
SCHEMBL2916059 0.88 PRMT1 (0.71) ALDH1A1PRMT1TAAR1TDP1HSD17B10
SCHEMBL10460741 0.88 ALDH1A1 (0.69) ALDH1A1PRMT1TAAR1TDP1HSD17B10
SCHEMBL13073499 0.88 TAAR1 (1.00) ALDH1A1PRMT1TAAR1TDP1HSD17B10
SCHEMBL14156120 0.88 ALDH1A1 (0.84) ALDH1A1PRMT1TAAR1TDP1HSD17B10
SCHEMBL625181 0.88 ALDH1A1 (0.84) ALDH1A1PRMT1TAAR1HSD17B10CA1
SCHEMBL10460354 0.88 ALDH1A1 (0.70) ALDH1A1PRMT1TAAR1TDP1HSD17B10

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 48 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107405318-A For treating the compound of the patient's condition related to nadph oxidase 格卢科克斯生物科技有限公司 2017-11-28 CN claimed
CN-103588697-B Disubstituted benzenes sulfamide compound of one class 2,5 and its production and use 中国科学院上海药物研究所 2017-09-15 CN claimed
US-20030216451-A1 Polycyclic aryl and heteroaryl substituted 4-pyrones useful for selective inhibition of the coagulation cascade PHARMACIA CORPORATION 2003-11-20 US claimed
US-11124482-B2 C-met modulators and methods of use EXELIXIS, INC. (US) 2021-09-21 US disclosed
US-20210253530-A9 C-MET MODULATORS AND METHODS OF USE EXELIXIS, INC. 2021-08-19 US disclosed
US-20200331860-A1 C-Met Modulators and Methods of Use EXELIXIS INC (US) 2020-10-22 US disclosed
CN-106146362-B Method for synthesizing C-7280948 南京理工大学 2018-04-03 CN disclosed
US-20170355678-A1 C-Met Modulators and Methods of Use EXELIXIS INC (US) 2017-12-14 US disclosed
CN-107405318-A For treating the compound of the patient's condition related to nadph oxidase 格卢科克斯生物科技有限公司 2017-11-28 CN disclosed
CN-103588697-B Disubstituted benzenes sulfamide compound of one class 2,5 and its production and use 中国科学院上海药物研究所 2017-09-15 CN disclosed
US-20160185725-A1 c-Met Modulators and Method of Use EXELIXIS, INC. 2016-06-30 US disclosed
US-7208488-B2 N-substituted benzene sulfonamides ELAN PHARMACEUTICALS, INC. (US) 2007-04-24 US disclosed
US-20070054928-A1 c-Met modulators and methods of use EXELIXIS, INC. (US) 2007-03-08 US disclosed
EP-1633732-A1 BENZYL SULFONAMIDE DERIVATIVES AS ANDROGEN RECEPTOR ANTAGONISTS WARNER-LAMBERT COMPANY (US) 2006-03-15 EP disclosed
US-20050165003-A1 Treating Alzheimer's Disease; 4-Chloro-N-(4-hydroxy-3-methoxy-benzyl)-N-(2-oxo-azepan-3-yl)-benzenesulfonamide for example; gamma secretase inhibitors; inhibition of beta-amyloid synthesis with minimal inhibition of Notch Signaling ELAN PHARMACEUTICALS, INC. 2005-07-28 US disclosed
WO-2004101544-A1 BENZYL SULFONAMIDE DERIVATIVES AS ANDROGEN RECEPTOR ANTAGONISTS WARNER-LAMBERT COMPANY LLC (US) 2004-11-25 WO disclosed
EP-0194548-A2 Sulfonylaminoethyl compounds, medicines containing these compounds and process for their preparation Dr. Karl Thomae GmbH (DE) 1986-09-17 EP disclosed
US-4443477-A ANTICOAGULANTS, ANTILIPEMIC AGENTS BOEHRINGER MANNHEIM GMBH (DE) 1984-04-17 US disclosed
EP-0031954-B1 SULPHONAMIDES, PROCESS FOR THEIR PREPARATION AND MEDICINES CONTAINING THESE COMPOUNDS Roche Diagnostics GmbH (DE) 1984-03-14 EP disclosed
EP-0031954-A2 Sulphonamides, process for their preparation and medicines containing these compounds Roche Diagnostics GmbH (DE) 1981-07-15 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20200331860-A1 C-Met Modulators and Methods of Use FLT4, FLT1, MET ALDH1A1 2072/4885PRMT1 254/4885TAAR1 3372/4885
US-20050165003-A1 Treating Alzheimer's Disease; 4-Chloro-N-(4-hydroxy-3-methoxy-benzyl)-N-(2-oxo-azepan-3-yl)-benzenesulfonamide for example; gamma secretase inhibitors; inhibition of beta-amyloid synthesis with minimal inhibition of Notch Signaling BACE1, PSEN1, BACE2 ALDH1A1 1694/4885PRMT1 111/4885TAAR1 2496/4885
US-20070054928-A1 c-Met modulators and methods of use FLT4, FLT1, MET ALDH1A1 2072/4885PRMT1 254/4885TAAR1 3372/4885
US-20170355678-A1 C-Met Modulators and Methods of Use FLT4, FLT1, MET ALDH1A1 2072/4885PRMT1 254/4885TAAR1 3372/4885
US-20210253530-A9 C-MET MODULATORS AND METHODS OF USE FLT4, FLT1, MET ALDH1A1 2072/4885PRMT1 254/4885TAAR1 3372/4885
US-20160185725-A1 c-Met Modulators and Method of Use FLT4, MET, FLT1 ALDH1A1 2578/4885PRMT1 516/4885TAAR1 3753/4885
US-11124482-B2 C-met modulators and methods of use FLT4, FLT1, MET ALDH1A1 2072/4885PRMT1 254/4885TAAR1 3372/4885
US-20030216451-A1 Polycyclic aryl and heteroaryl substituted 4-pyrones useful for selective inhibition of the coagulation cascade TFPI, PLAT, F2 ALDH1A1 3342/4885PRMT1 3494/4885TAAR1 4436/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.